ID: 69700
SMILES:Oc1c(C(OC)=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 69701
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 69702
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 69703
SMILES:c1(CCCCC)cc(O)c2c(c1C=CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.869
InChIKey:VSPKLPHYKGYOTH-UHFFFAOYSA-N
ID: 69704
SMILES:C=C1CC(c2c(O)cc(CCCCC)cc2OC)OC(=O)C(CC2CC(C)=CC(=O)O2)=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -13.071
InChIKey:FYQTWUPSXKGOLJ-UHFFFAOYSA-N
ID: 69705
SMILES:CC(=CCCC1(C)Oc2c(cc(CCCCC)cc2O)C=C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.809
InChIKey:VTCIPNPUHLUJLA-UHFFFAOYSA-N
ID: 69706
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(=O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.929
InChIKey:IGXHGXINLFGJKW-UHFFFAOYSA-N
ID: 69707
SMILES:C1CC(C)(C)C2C(c3c(O)cc(CCCCC#CC)cc3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -14.402
InChIKey:ATZIJJIXLHSVAH-UHFFFAOYSA-N
ID: 69708
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 69709
SMILES:c1c(O)c(C(=O)C(CC)C)c2c(c1O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.604
InChIKey:VWTHNNZUPUPSLT-UHFFFAOYSA-N
ID: 69710
SMILES:C1(O)C(O)C(C)C2(C(C)=C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.069
InChIKey:LPTHCLOQUOIXMP-UHFFFAOYSA-N
ID: 69711
SMILES:C(C)(c1cc(=O)c2c(cc1O)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.839
InChIKey:IBSRZGXHKZQYTO-UHFFFAOYSA-N
ID: 69712
SMILES:C1(C(C)=C)C(c2c(O)cc(CCC)cc2OC)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.854
InChIKey:OZYYEDPTJXVZJQ-UHFFFAOYSA-N
ID: 69713
SMILES:CC1(CC=CC(C)C)Oc2cc(OC)cc(C)c2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.109
InChIKey:QGXXLMMSIPAQLN-UHFFFAOYSA-N
ID: 69714
SMILES:C(=CCCC(=C)C=CCC1(C)Oc2c(c(O)c(C(O)=O)c(CCCCC)c2)C(O)=C1C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.59
InChIKey:DMSHQPRLBZEHCJ-UHFFFAOYSA-N
ID: 69715
SMILES:O(c1c2c(cc(C(C)(CCCCC)C)c1)OC(C)(C)C1CCC(C)=CC21)C=CC1(O)COC(C=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.77
CB1 binding score: -15.011
InChIKey:JDIWROFFJXGKQP-UHFFFAOYSA-N
ID: 69716
SMILES:C(=O)(C1=C2C(c3c(cc(CCCCC)cc3O)O1)C(C)CC2)OC(C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: Not available
InChIKey:QJLCLFWHYWLKRN-UHFFFAOYSA-N
ID: 69717
SMILES:CC(C)C1CCC2(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 69718
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 69719
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(OC)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.167
InChIKey:QYJGHZXOIWLFTA-UHFFFAOYSA-N
ID: 69720
SMILES:C1(C)C(=O)C(CC=C(C)C)=C(O)c2c1cc(CCCCC)cc2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.423
InChIKey:JSMDZCXHTUHVFS-UHFFFAOYSA-N